BDBM50468975 CHEMBL4283913

SMILES: ONC(=O)c1ccc(CN2CC3(CCCCC3)c3ccccc23)cc1

InChI Key: InChIKey=MSFUCFYAMWIZCT-UHFFFAOYSA-N

Data: 3 IC50

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50468975   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Cereblon/Histone deacetylase 1 (Homo sapiens (Human))	BDBM50468975 (CHEMBL4283913) Show SMILES ONC(=O)c1ccc(CN2CC3(CCCCC3)c3ccccc23)cc1 Show InChI InChI=1S/C21H24N2O2/c24-20(22-25)17-10-8-16(9-11-17)14-23-15-21(12-4-1-5-13-21)18-6-2-3-7-19(18)23/h2-3,6-11,25H,1,4-5,12-15H2,(H,22,24)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	6.79E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Siena Curated by ChEMBL					Assay Description Inhibition of human recombinant C-terminal His/FLAG-tagged full length HDAC1 expressed in insect SF9 cells using fluorogenic ZMAL as substrate after ...				Eur J Med Chem 157: 127-138 (2018) Article DOI: 10.1016/j.ejmech.2018.07.069 BindingDB Entry DOI: 10.7270/Q2PZ5CJ3
					More data for this Ligand-Target Pair
Histone deacetylase 8 (Homo sapiens (Human))	BDBM50468975 (CHEMBL4283913) Show SMILES ONC(=O)c1ccc(CN2CC3(CCCCC3)c3ccccc23)cc1 Show InChI InChI=1S/C21H24N2O2/c24-20(22-25)17-10-8-16(9-11-17)14-23-15-21(12-4-1-5-13-21)18-6-2-3-7-19(18)23/h2-3,6-11,25H,1,4-5,12-15H2,(H,22,24)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	253	n/a	n/a	n/a	n/a	n/a	n/a
University of Siena Curated by ChEMBL					Assay Description Inhibition of human recombinant HDAC8 using fluor de Lys(R) as substrate after 90 mins by fluorescence-based assay				Eur J Med Chem 157: 127-138 (2018) Article DOI: 10.1016/j.ejmech.2018.07.069 BindingDB Entry DOI: 10.7270/Q2PZ5CJ3
					More data for this Ligand-Target Pair
Cereblon/Histone deacetylase 6 (Homo sapiens (Human))	BDBM50468975 (CHEMBL4283913) Show SMILES ONC(=O)c1ccc(CN2CC3(CCCCC3)c3ccccc23)cc1 Show InChI InChI=1S/C21H24N2O2/c24-20(22-25)17-10-8-16(9-11-17)14-23-15-21(12-4-1-5-13-21)18-6-2-3-7-19(18)23/h2-3,6-11,25H,1,4-5,12-15H2,(H,22,24)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	41	n/a	n/a	n/a	n/a	n/a	n/a
University of Siena Curated by ChEMBL					Assay Description Inhibition of human recombinant N-terminal GST-tagged full length HDAC6 expressed in insect SF9 cells using fluorogenic ZMAL as substrate after 90 mi...				Eur J Med Chem 157: 127-138 (2018) Article DOI: 10.1016/j.ejmech.2018.07.069 BindingDB Entry DOI: 10.7270/Q2PZ5CJ3
					More data for this Ligand-Target Pair